0 mol 1 unq 0 iso 0 dist 8.93702 14.7542 9.78935 7.48521 5.96833 7.28542 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 4.82549 6.66586 7.38586 10.0518 9.35562 15.9925 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 4.82549 6.66586 7.38586 6.53652 8.63857 4.7793 numMergedOcc 0
3 mol 128 unq 0 iso 0 dist 6.12126 4.73835 9.11128 5.61773 6.47811 10.0983 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 9.59094 11.8191 6.61636 13.2035 9.10003 4.97581 numMergedOcc 0
5 mol 195 unq 0 iso 0 dist 8.64561 8.61846 9.71653 11.5968 9.74988 6.01032 numMergedOcc 0
6 mol 214 unq 0 iso 0 dist 8.20906 8.78538 6.96139 5.055 9.58372 10.0389 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 7.83547 8.93948 5.91133 6.70989 8.98681 11.812 numMergedOcc 0
8 mol 220 unq 1 iso 0 dist 7.83547 10.5175 9.49722 6.70989 8.98681 4.606 numMergedOcc 0
9 mol 228 unq 0 iso 0 dist 9.79291 11.4093 4.42593 14.2513 8.66946 6.25439 numMergedOcc 0
10 mol 228 unq 1 iso 0 dist 9.79291 11.4093 4.42593 11.0879 8.55761 5.17467 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 5.34745 5.35285 5.64376 6.49444 8.24424 8.21114 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 5.34745 5.35285 5.64376 6.63339 7.0942 5.73999 numMergedOcc 0
13 mol 233 unq 2 iso 0 dist 5.34745 5.35285 5.64376 9.86764 6.01775 9.13536 numMergedOcc 0
14 mol 233 unq 3 iso 0 dist 7.99897 12.5285 5.64376 9.1334 8.24424 8.21114 numMergedOcc 0
15 mol 233 unq 4 iso 0 dist 7.99897 12.5285 5.64376 9.81222 7.0942 5.73999 numMergedOcc 0
16 mol 233 unq 5 iso 0 dist 7.99897 12.5285 5.64376 5.17683 6.01775 9.13536 numMergedOcc 0
17 mol 233 unq 6 iso 0 dist 8.98366 6.13888 5.64376 12.3327 8.24424 8.21114 numMergedOcc 0
18 mol 233 unq 7 iso 0 dist 8.98366 6.13888 5.64376 8.89879 7.0942 5.73999 numMergedOcc 0
19 mol 233 unq 8 iso 0 dist 8.98366 6.13888 5.64376 9.7363 6.01775 9.13536 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.07397 14.9777 6.40309 13.4501 7.39547 5.36582 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 8.91763 5.46945 6.40309 8.28104 7.39547 5.36582 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 9.16587 12.2642 8.5372 13.0023 9.66641 8.2786 numMergedOcc 0
23 mol 254 unq 1 iso 0 dist 9.16587 12.2642 8.5372 12.1584 9.26575 5.20737 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 6.29389 11.7857 7.58405 12.978 8.5613 4.35925 numMergedOcc 0
25 mol 260 unq 1 iso 0 dist 9.50619 6.39739 7.26115 9.31424 5.7791 4.35925 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 8.70062 5.87542 8.40198 9.8719 8.59762 13.2367 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 8.70062 11.8104 9.11967 9.8719 8.59762 12.7902 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 8.70062 5.87542 8.40198 9.8719 8.59762 13.2367 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 8.70062 11.8104 9.11967 9.8719 8.59762 12.7902 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 8.70062 5.87542 8.40198 9.8719 8.59762 13.2367 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 8.70062 11.8104 9.11967 9.8719 8.59762 12.7902 numMergedOcc 0
